CID 205815

18703-83-8

Structural Information

Molecular Formula
C15H21NO4
SMILES
COC1=CC(=C(C=C1)C(=O)CCN2CCOCC2)OC
InChI
InChI=1S/C15H21NO4/c1-18-12-3-4-13(15(11-12)19-2)14(17)5-6-16-7-9-20-10-8-16/h3-4,11H,5-10H2,1-2H3
InChIKey
LRMNBXLXQZOSKD-UHFFFAOYSA-N
Compound name
1-(2,4-dimethoxyphenyl)-3-morpholin-4-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

279.14706 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.15434 164.8
[M+Na]+ 302.13628 169.6
[M-H]- 278.13978 169.8
[M+NH4]+ 297.18088 177.7
[M+K]+ 318.11022 169.1
[M+H-H2O]+ 262.14432 156.1
[M+HCOO]- 324.14526 182.3
[M+CH3COO]- 338.16091 199.3
[M+Na-2H]- 300.12173 167.6
[M]+ 279.14651 166.3
[M]- 279.14761 166.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe